# generated using pymatgen
data_Li4MnCo2O7
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.03040900
_cell_length_b   5.06901587
_cell_length_c   16.74180401
_cell_angle_alpha   90.07881306
_cell_angle_beta   92.41171127
_cell_angle_gamma   91.41734314
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li4MnCo2O7
_chemical_formula_sum   'Li8 Mn2 Co4 O14'
_cell_volume   256.86689766
_cell_formula_units_Z   2
loop_
 _symmetry_equiv_pos_site_id
 _symmetry_equiv_pos_as_xyz
  1  'x, y, z'
loop_
 _atom_site_type_symbol
 _atom_site_label
 _atom_site_symmetry_multiplicity
 _atom_site_fract_x
 _atom_site_fract_y
 _atom_site_fract_z
 _atom_site_occupancy
  Li  Li0  1  0.92177900  0.35975200  0.85575600  1
  Li  Li1  1  0.34729300  0.21930400  0.71308700  1
  Li  Li2  1  0.78544200  0.07131700  0.57130100  1
  Li  Li3  1  0.22315400  0.92273500  0.42868900  1
  Li  Li4  1  0.64637900  0.78496600  0.28681500  1
  Li  Li5  1  0.07357800  0.64374700  0.14380800  1
  Li  Li6  1  0.50104700  0.50063200  0.00040900  1
  Li  Li7  1  0.28455300  0.57112200  0.57069400  1
  Mn  Mn8  1  0.01432400  0.00117600  0.00081900  1
  Mn  Mn9  1  0.42246600  0.85265200  0.85440600  1
  Co  Co10  1  0.83711400  0.71172700  0.70596800  1
  Co  Co11  1  0.71660700  0.42807600  0.43468500  1
  Co  Co12  1  0.14231200  0.28941100  0.28823300  1
  Co  Co13  1  0.58306900  0.14671500  0.14575800  1
  O  O14  1  0.43385400  0.15995000  0.92627500  1
  O  O15  1  0.86098300  0.00134100  0.78187400  1
  O  O16  1  0.28652600  0.88273300  0.64708600  1
  O  O17  1  0.74424000  0.71611700  0.49092900  1
  O  O18  1  0.13941300  0.58535000  0.35787100  1
  O  O19  1  0.61310700  0.44651700  0.21535400  1
  O  O20  1  0.06190800  0.30140700  0.07361500  1
  O  O21  1  0.41543100  0.55307800  0.78352400  1
  O  O22  1  0.82205400  0.42433900  0.64970400  1
  O  O23  1  0.27356400  0.25942900  0.49407000  1
  O  O24  1  0.66488300  0.14119700  0.35919500  1
  O  O25  1  0.10457500  0.98715800  0.21715600  1
  O  O26  1  0.58438800  0.84281800  0.07395900  1
  O  O27  1  0.99595700  0.69523400  0.92896000  1
